basic_info |
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Product_Name: | 3-(CYANOMETHANESULFONYL)-2,6-DIFLUOROBENZOIC ACID |
EnglishSynonyms: | 3-(CYANOMETHANESULFONYL)-2,6-DIFLUOROBENZOIC ACID |
pro_mdlNumber: | MFCD11179946 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | c1cc(c(c(c1F)C(=O)O)F)S(=O)(=O)CC#N |
InChi: | InChI=1S/C9H5F2NO4S/c10-5-1-2-6(17(15,16)4-3-12)8(11)7(5)9(13)14/h1-2H,4H2,(H,13,14) |
InChiKey: | InChIKey=INHDWWRYTCWCJR-UHFFFAOYSA-N |
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